ethyl 4-[(6,7-dimethoxy-2-propanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate

Systemtic Name: ethyl 4-[(6,7-dimethoxy-2-propanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate Openeye Name: ethyl 4-[(6,7-dimethoxy-2-propanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate CAS Name: 4-[[6,7-dimethoxy-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(6,7-dimethoxy-2-propanoyl-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoate Traditional Name: 4-[(6,7-dimethoxy-2-propionyl-3,4-dihydro-1H-isoquinolin-1-yl)methoxy]benzoic acid ethyl ester Formula: C24H29NO6 MolecularWeight: 427.49016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=C(C=C3)C(=O)OCC)OC)OC

Isomeric SMILES

CCC(=O)N1CCC2=CC(=C(C=C2C1COC3=CC=C(C=C3)C(=O)OCC)OC)OC

InChI

InChI=1S/C24H29NO6/c1-5-23(26)25-12-11-17-13-21(28-3)22(29-4)14-19(17)20(25)15-31-18-9-7-16(8-10-18)24(27)30-6-2/h7-10,13-14,20H,5-6,11-12,15H2,1-4H3